methyl 5-[4-(4-nitrophenyl)piperazin-1-yl]carbonylthiophene-2-carboxylate

Systemtic Name: methyl 5-[4-(4-nitrophenyl)piperazin-1-yl]carbonylthiophene-2-carboxylate Openeye Name: methyl 5-[4-(4-nitrophenyl)piperazine-1-carbonyl]thiophene-2-carboxylate CAS Name: 5-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[4-(4-nitrophenyl)piperazine-1-carbonyl]thiophene-2-carboxylate Traditional Name: 5-[4-(4-nitrophenyl)piperazine-1-carbonyl]thiophene-2-carboxylic acid methyl ester Formula: C17H17N3O5S MolecularWeight: 375.39898

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(S1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(S1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O5S/c1-25-17(22)15-7-6-14(26-15)16(21)19-10-8-18(9-11-19)12-2-4-13(5-3-12)20(23)24/h2-7H,8-11H2,1H3